Geometry & MOs

Info

ID:	253482
PubChem CID:	103118709
Reduced:	O3N4C12H22 (1)
Stoich.:	A3B4C12D22 (1)
Weight, g/mol:	241.132746
ΔH_f, kcal/mol:	-98.74
Dipole, Da:	3.87
IP(EA), eV:	-9.85(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-5-(1-methylindazol-3-yl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC(C)(CCN1C(=C(N=N1)C(=O)OC)CCN)OC

DOS

IR

Vibrations