Geometry & MOs

Info

ID:	183863
PubChem CID:	77082997
Reduced:	SN2O2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	259.043378
ΔH_f, kcal/mol:	-29.62
Dipole, Da:	3.24
IP(EA), eV:	-8.78(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(oxan-2-ylmethyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC2=CC(=CC=C2)OCCO)C3=NC=CS3

DOS

IR

Vibrations