Geometry & MOs

Info

ID:	248006
PubChem CID:	103078117
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	216.137497
ΔH_f, kcal/mol:	75.8
Dipole, Da:	4.24
IP(EA), eV:	-7.94(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-[(2-methylphenyl)methyl]pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)NCCC2=CN=CC=C2)N

DOS

IR

Vibrations