Geometry & MOs

Info

ID:	146332
PubChem CID:	53671598
Reduced:	NF3C11H12 (1)
Stoich.:	AB3C11D12 (1)
Weight, g/mol:	334.168128
ΔH_f, kcal/mol:	-133.92
Dipole, Da:	5.5
IP(EA), eV:	-8.65(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-cyanophenyl)iminomethyl]phenyl]methyl 2,2-dimethylbutanoate

Drug info:

PubChemData

Smile

CC=CCNC1=CC=CC(=C1)C(F)(F)F

DOS

IR

Vibrations