Geometry & MOs

Info

ID:	183783
PubChem CID:	77069939
Reduced:	BrN3O3C14H20 (1)
Stoich.:	AB3C3D14E20 (1)
Weight, g/mol:	346.03169
ΔH_f, kcal/mol:	-80.86
Dipole, Da:	1.78
IP(EA), eV:	-8.84(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-5-methoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCC(CC)(C(=NO)N)C(=O)NC1=C(C=CC(=C1)OC)Br

DOS

IR

Vibrations