Geometry & MOs

Info

ID:	170786
PubChem CID:	75280048
Reduced:	N2O3C21H30 (1)
Stoich.:	A2B3C21D30 (1)
Weight, g/mol:	420.241293
ΔH_f, kcal/mol:	-146.74
Dipole, Da:	5.97
IP(EA), eV:	-9.41(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(methoxymethyl)-2-oxo-3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-7-yl]-3,3-diphenylpropanamide

Drug info:

PubChemData

Smile

COCC1CC(=O)NC2C1CCC(C2)NC(=O)CCCC3=CC=CC=C3

DOS

IR

Vibrations