Geometry & MOs

Info

ID:	324786
PubChem CID:	126678346
Reduced:	FPN2O3H14C17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	373.131408
ΔH_f, kcal/mol:	-59.84
Dipole, Da:	3.05
IP(EA), eV:	-8.09(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-methoxyphenyl)methyl]-3-oxo-2-phenyl-1,4-benzoxazine-6-carbaldehyde

Drug info:

PubChemData

Smile

CC1C2=C(C=CC=C2P=C3N1C4=C(C=CC(=C4)C(=O)NO)OC3)F

DOS

IR

Vibrations