Geometry & MOs

Info

ID:	353557
PubChem CID:	127285134
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	312.195011
ΔH_f, kcal/mol:	-3.84
Dipole, Da:	2.44
IP(EA), eV:	-9.99(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylcyclopentyl)-2-[5-methyl-1-(4-methylphenyl)triazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCCC1NC(=O)C2=NOC(=C2)C3=CC=NC=C3

DOS

IR

Vibrations