Geometry & MOs

Info

ID:	273246
PubChem CID:	103770757
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	253.179027
ΔH_f, kcal/mol:	-89.24
Dipole, Da:	1.63
IP(EA), eV:	-8.7(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylpyrazol-1-yl)-N-(2-hydroxy-4-methylpentyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations