Geometry & MOs

Info

ID:	255560
PubChem CID:	103132978
Reduced:	ON3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	181.121512
ΔH_f, kcal/mol:	27.1
Dipole, Da:	5.6
IP(EA), eV:	-9.3(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-(1-methylpyrazol-3-yl)pentan-1-one

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)CC(C2=CC=CC=C2)N

DOS

IR

Vibrations