Geometry & MOs

Info

ID:	255632
PubChem CID:	103133607
Reduced:	ON2C11H24 (1)
Stoich.:	AB2C11D24 (1)
Weight, g/mol:	181.121512
ΔH_f, kcal/mol:	-68.4
Dipole, Da:	2.12
IP(EA), eV:	-8.63(2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-methyl-1-(1-methylpyrazol-3-yl)butan-1-one

Drug info:

PubChemData

Smile

CC1CCC(O1)CN(C)CC(C)CN

DOS

IR

Vibrations