Geometry & MOs

Info

ID:	76405
PubChem CID:	48424882
Reduced:	N2O4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	301.204179
ΔH_f, kcal/mol:	-144.95
Dipole, Da:	1.0
IP(EA), eV:	-8.9(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[2-(3,4-dimethylphenyl)pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C)OCC1=CC(=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations