Geometry & MOs

Info

ID:	195925
PubChem CID:	78749702
Reduced:	NO6C22H25 (1)
Stoich.:	AB6C22D25 (1)
Weight, g/mol:	387.148201
ΔH_f, kcal/mol:	-199.23
Dipole, Da:	8.37
IP(EA), eV:	-8.46(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] 3-(3,5-dimethoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)C=CC2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations