Geometry & MOs

Info

ID:	345769
PubChem CID:	127270069
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	264.220164
ΔH_f, kcal/mol:	-37.89
Dipole, Da:	4.03
IP(EA), eV:	-9.6(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)cycloheptanecarboxamide

Drug info:

PubChemData

Smile

CC1=NC=C2CN(CCC2=N1)C(=O)C3CCCCCC3

DOS

IR

Vibrations