Geometry & MOs

Info

ID:	291659
PubChem CID:	113456202
Reduced:	BrNO4C12H14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	389.88601
ΔH_f, kcal/mol:	-153.56
Dipole, Da:	5.76
IP(EA), eV:	-10.15(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-amino-2-bromo-4-methylphenyl)-3-bromothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(CC1=NC=C(C=C1)Br)C(=O)O

DOS

IR

Vibrations