Geometry & MOs

Info

ID:	347575
PubChem CID:	127272430
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	369.151098
ΔH_f, kcal/mol:	-81.31
Dipole, Da:	7.0
IP(EA), eV:	-10.1(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-anilinopyrrolidin-1-yl)-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone

Drug info:

PubChemData

Smile

CC(CN1C(=O)C2(CCCCC2)N(C1=O)C)C#N

DOS

IR

Vibrations