Geometry & MOs

Info

ID:	76317
PubChem CID:	48424775
Reduced:	O3N4C23H30 (1)
Stoich.:	A3B4C23D30 (1)
Weight, g/mol:	380.10994
ΔH_f, kcal/mol:	-88.56
Dipole, Da:	1.19
IP(EA), eV:	-8.28(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(3-bromophenyl)pyrrolidin-3-yl]methyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2=CC(=CC=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)OC

DOS

IR

Vibrations