Geometry & MOs

Info

ID:	253426
PubChem CID:	103118364
Reduced:	BrON4H11C14 (1)
Stoich.:	ABC4D11E14 (1)
Weight, g/mol:	347.00695
ΔH_f, kcal/mol:	51.34
Dipole, Da:	1.14
IP(EA), eV:	-9.01(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-4-fluorophenyl)-1-methylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Br)NC(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations