Geometry & MOs

Info

ID:	276827
PubChem CID:	103825412
Reduced:	N2O3C16H30 (1)
Stoich.:	A2B3C16D30 (1)
Weight, g/mol:	279.1293
ΔH_f, kcal/mol:	-184.8
Dipole, Da:	2.33
IP(EA), eV:	-9.37(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)-2,3-dihydro-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCC(C1)C(=O)NCC(C)(C)CCO

DOS

IR

Vibrations