Geometry & MOs

Info

ID:

47400

PubChem CID:

10532391

Reduced:

N3O10C34H51 (1)

Stoich.:

A3B10C34D51 (1)

Weight, g/mol:

661.291864

ΔHf, kcal/mol:

-390.13

Dipole, Da:

7.55

IP(EA), eV:

 -8.66(-0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3,3-diphenylpropyl-[3-[5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]oxy-3-methylbutyl]-methylazanium;chloride

Drug info:

PubChemData

Smile

CC(C)C[C@H]([C@@H](C(=O)N(CC1=C(C=C(C=C1OC)OC)OC)OCC2=C(C=C(C=C2)OC)OC)O)C(=O)N[C@H](C(=O)NC)C(C)(C)C

DOS

IR

Vibrations