Geometry & MOs

Info

ID:	269521
PubChem CID:	103617833
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	383.89657
ΔH_f, kcal/mol:	-45.36
Dipole, Da:	3.7
IP(EA), eV:	-10.22(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-2,2-dimethyl-3-oxopropyl)-4,5-dibromothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC=CC(=C1)C#N)C(=O)N

DOS

IR

Vibrations