Geometry & MOs

Info

ID:	358000
PubChem CID:	127295514
Reduced:	ON4C17H28 (1)
Stoich.:	AB4C17D28 (1)
Weight, g/mol:	318.241962
ΔH_f, kcal/mol:	-14.79
Dipole, Da:	4.95
IP(EA), eV:	-8.53(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclohexyl)-2-(3-piperidin-1-ylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(C#N)(C1CC1)NC(=O)CN2CCC(C2)N3CCCCC3

DOS

IR

Vibrations