Geometry & MOs

Info

ID:	88808
PubChem CID:	49956950
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	295.157229
ΔH_f, kcal/mol:	-61.03
Dipole, Da:	5.4
IP(EA), eV:	-8.75(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)OC(C)C

DOS

IR

Vibrations