Geometry & MOs

Info

ID:	142435
PubChem CID:	53033821
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	309.111341
ΔH_f, kcal/mol:	19.94
Dipole, Da:	1.53
IP(EA), eV:	-8.63(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(5-methylindazole-1-carbonyl)amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)N2C3=C(C=C(C=C3)C)C=N2)C

DOS

IR

Vibrations