Geometry & MOs

Info

ID:	176894
PubChem CID:	76108107
Reduced:	FNC18H20 (1)
Stoich.:	ABC18D20 (1)
Weight, g/mol:	462.215472
ΔH_f, kcal/mol:	-3.78
Dipole, Da:	2.2
IP(EA), eV:	-9.1(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[cyano-(3-phenoxyphenyl)methyl] 3-[3-[2-(dimethylamino)ethoxy]-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(C)N=CCC2=CC=CC=C2F

DOS

IR

Vibrations