Geometry & MOs

Info

ID:	369072
PubChem CID:	127331214
Reduced:	SN3O3C14H17 (1)
Stoich.:	AB3C3D14E17 (1)
Weight, g/mol:	345.151098
ΔH_f, kcal/mol:	-101.21
Dipole, Da:	3.24
IP(EA), eV:	-8.72(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopropanecarbonylamino)-N-(2,3-dihydro-1-benzothiophen-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)NC2CSC3=CC=CC=C23)C(=O)N

DOS

IR

Vibrations