Geometry & MOs

Info

ID:	248007
PubChem CID:	103078119
Reduced:	NC3H4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	218.083747
ΔH_f, kcal/mol:	62.63
Dipole, Da:	2.6
IP(EA), eV:	-7.81(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-(2-methylsulfonylethyl)pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CNC2=NN(C=C2N)C

DOS

IR

Vibrations