Geometry & MOs

Info

ID:	273606
PubChem CID:	103771455
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	281.14495
ΔH_f, kcal/mol:	-153.5
Dipole, Da:	2.36
IP(EA), eV:	-9.37(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)N=CNC2=O)C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations