Geometry & MOs

Info

ID:	404990
PubChem CID:	135072039
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	370.169271
ΔH_f, kcal/mol:	-71.39
Dipole, Da:	5.59
IP(EA), eV:	-9.36(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(E)-(2-fluoro-3-oxo-1,3-diphenylpropylidene)amino]-N-methylcarbamate

Drug info:

PubChemData

Smile

CCCCCC=C=CC1=C(C=CN=C1)NC(=O)OC(C)(C)C

DOS

IR

Vibrations