Geometry & MOs

Info

ID:	150938
PubChem CID:	53790635
Reduced:	OC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	494.205301
ΔH_f, kcal/mol:	-63.82
Dipole, Da:	5.1
IP(EA), eV:	-9.14(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1R)-1-methoxy-3-methyl-1-phenylbutan-2-yl]oxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=C(C2=CC=CC=C2C=C1)CC(=O)O

DOS

IR

Vibrations