Geometry & MOs

Info

ID:	395708
PubChem CID:	135026290
Reduced:	ON3C7H10 (2)
Stoich.:	AB3C7D10 (2)
Weight, g/mol:	366.180424
ΔH_f, kcal/mol:	12.62
Dipole, Da:	7.03
IP(EA), eV:	-9.59(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(E)-[1-phenyl-2,2-di(pyrazol-1-yl)ethylidene]amino]carbamate

Drug info:

PubChemData

Smile

CC(=NNC(=O)OC(C)(C)C)C(N1C=CC=N1)N2C=CC=N2

DOS

IR

Vibrations