Geometry & MOs

Info

ID:	273268
PubChem CID:	103770793
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	270.132805
ΔH_f, kcal/mol:	-134.14
Dipole, Da:	2.13
IP(EA), eV:	-9.56(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2-(3-nitropyrazol-1-yl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations