Geometry & MOs

Info

ID:	166553
PubChem CID:	74708004
Reduced:	ClO2N6C23H33 (1)
Stoich.:	AB2C6D23E33 (1)
Weight, g/mol:	403.145344
ΔH_f, kcal/mol:	-41.27
Dipole, Da:	3.8
IP(EA), eV:	-8.5(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenoxyethyl 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)CCN1C2C(=[N+](C(=O)N(C2=O)C)C)N=C1C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations