Geometry & MOs

Info

ID:	165137
PubChem CID:	74503959
Reduced:	N3O4C23H33 (1)
Stoich.:	A3B4C23D33 (1)
Weight, g/mol:	351.042899
ΔH_f, kcal/mol:	-90.36
Dipole, Da:	11.49
IP(EA), eV:	-6.07(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dichlorophenyl)-N-(2,5-dimethoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

COC(=O)C1CC[NH+](CC1)CC(COC2=CC=C(C=C2)C[NH2+]CC3=CN=CC=C3)O

DOS

IR

Vibrations