Geometry & MOs

Info

ID:	254125
PubChem CID:	103122866
Reduced:	ClON4C11H13 (1)
Stoich.:	ABC4D11E13 (1)
Weight, g/mol:	309.04767
ΔH_f, kcal/mol:	6.81
Dipole, Da:	0.93
IP(EA), eV:	-9.66(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromobutyl)-1-methylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC(CNC(=O)C1=C2C=NC=CN2N=C1)Cl

DOS

IR

Vibrations