Geometry & MOs

Info

ID:	196064
PubChem CID:	78775680
Reduced:	SO2N3H23C24 (1)
Stoich.:	AB2C3D23E24 (1)
Weight, g/mol:	388.15537
ΔH_f, kcal/mol:	-6.83
Dipole, Da:	4.04
IP(EA), eV:	-8.84(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chloro-5-ethoxy-4-propoxyphenyl)-N-(1-pyridin-4-ylethyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C1=CC=NC=C1)NC(=O)C2=CC=CC=C2SCC(=O)N3CCC4=CC=CC=C43

DOS

IR

Vibrations