Geometry & MOs

Info

ID:	273618
PubChem CID:	103771492
Reduced:	N2O3C16H30 (1)
Stoich.:	A2B3C16D30 (1)
Weight, g/mol:	212.127326
ΔH_f, kcal/mol:	-189.19
Dipole, Da:	4.37
IP(EA), eV:	-9.66(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2H-triazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1CCCN(C1)C(=O)C(C)C)O

DOS

IR

Vibrations