Geometry & MOs

Info

ID:	359318
PubChem CID:	127298332
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	305.185175
ΔH_f, kcal/mol:	-151.07
Dipole, Da:	8.73
IP(EA), eV:	-9.22(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[1-(2H-triazole-4-carbonyl)piperidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C(=O)CCC2)C(=O)N3CCC(CC3)NC(=O)CC4CCCC4

DOS

IR

Vibrations