Geometry & MOs

Info

ID:	374799
PubChem CID:	131345536
Reduced:	ON4C8H8 (1)
Stoich.:	AB4C8D8 (1)
Weight, g/mol:	176.069811
ΔH_f, kcal/mol:	41.26
Dipole, Da:	2.17
IP(EA), eV:	-9.64(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-1H-pyrrol-3-yl)-(1H-pyrazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC(=O)C1=CN=CN1C2=CC=NN2

DOS

IR

Vibrations