Geometry & MOs

Info

ID:	233632
PubChem CID:	91146636
Reduced:	NSC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	192.087192
ΔH_f, kcal/mol:	8.61
Dipole, Da:	0.98
IP(EA), eV:	-8.36(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-5-methylpyrazol-4-ylidene)amino]-1H-1,2,4-triazol-5-amine

Drug info:

PubChemData

Smile

CC(C)(C)C.CC(C)(C)NSC1=NC2=CC=CC=C2S1

DOS

IR

Vibrations