Geometry & MOs

Info

ID:	276013
PubChem CID:	103819917
Reduced:	NO2C11H21 (1)
Stoich.:	AB2C11D21 (1)
Weight, g/mol:	211.132077
ΔH_f, kcal/mol:	-119.8
Dipole, Da:	2.7
IP(EA), eV:	-9.67(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-3-methylbutyl)-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(CNC(=O)CC1CCC1)O

DOS

IR

Vibrations