Geometry & MOs

Info

ID:	155476
PubChem CID:	56365781
Reduced:	O3N4C28H36 (1)
Stoich.:	A3B4C28D36 (1)
Weight, g/mol:	469.13649
ΔH_f, kcal/mol:	-115.38
Dipole, Da:	6.31
IP(EA), eV:	-8.17(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(4-bromophenyl)methyl]cyclohexyl]-5-oxo-1-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC(C(=O)NC1=CC(=CC=C1)N2CCCC2)NC(=O)C3CC(=O)N(C3)CC4=CC=C(C=C4)C

DOS

IR

Vibrations