Geometry & MOs

Info

ID:	312240
PubChem CID:	126603807
Reduced:	NO7C21H35 (1)
Stoich.:	AB7C21D35 (1)
Weight, g/mol:	162.031694
ΔH_f, kcal/mol:	-293.21
Dipole, Da:	2.61
IP(EA), eV:	-8.65(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)/C=C/OC(C)(C)C1[C@@H]([C@@H](CC[C@]12CO2)OC(=O)N3C[C@@H]([C@H](C3)O)O)OC

DOS

IR

Vibrations