Geometry & MOs

Info

ID:	130878
PubChem CID:	51119868
Reduced:	SO3N6C21H24 (1)
Stoich.:	AB3C6D21E24 (1)
Weight, g/mol:	374.049191
ΔH_f, kcal/mol:	-22.46
Dipole, Da:	6.03
IP(EA), eV:	-9.21(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(4-chlorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl]furan-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=CC=C2)S(=O)(=O)N3CCN(CC3)C(C)C(=O)NC4=NC=CC=N4)N=C1

DOS

IR

Vibrations