Geometry & MOs

Info

ID:	137935
PubChem CID:	52287478
Reduced:	O2N3C22H27 (1)
Stoich.:	A2B3C22D27 (1)
Weight, g/mol:	381.241627
ΔH_f, kcal/mol:	-50.73
Dipole, Da:	5.86
IP(EA), eV:	-8.55(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetyl-N,5-dimethyl-3-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC=CC(=C1)C(=O)N(C)CC2=CC=CC=C2N3CCCC3

DOS

IR

Vibrations