Geometry & MOs

Info

ID:	172221
PubChem CID:	75481506
Reduced:	ClSO2C3N3H4 (1)
Stoich.:	ABC2D3E3F4 (1)
Weight, g/mol:	147.079647
ΔH_f, kcal/mol:	-23.07
Dipole, Da:	2.47
IP(EA), eV:	-11.41(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-(1H-pyrrol-3-yl)pyrazole

Drug info:

PubChemData

Smile

CN1C(=CN=N1)S(=O)(=O)Cl

DOS

IR

Vibrations