Geometry & MOs

Info

ID:	123293
PubChem CID:	50840870
Reduced:	SN3O3C21H21 (1)
Stoich.:	AB3C3D21E21 (1)
Weight, g/mol:	356.163711
ΔH_f, kcal/mol:	-57.44
Dipole, Da:	4.15
IP(EA), eV:	-9.15(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-N-(pyridin-2-ylmethyl)indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)C3=C(C=C(C=C3)C(=O)OC)N=C2N4CCSC4

DOS

IR

Vibrations