Geometry & MOs

Info

ID:	265611
PubChem CID:	103533183
Reduced:	NO2C7H13 (2)
Stoich.:	AB2C7D13 (2)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-177.96
Dipole, Da:	5.29
IP(EA), eV:	-8.89(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-aminophenyl)-1-(3,4-dimethoxypyrrolidin-1-yl)-2-methylpropan-1-one

Drug info:

PubChemData

Smile

COC1CN(CC1OC)C(=O)CCOC2CCNCC2

DOS

IR

Vibrations