Geometry & MOs

Info

ID:	401604
PubChem CID:	135051816
Reduced:	N2O3H16C17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	415.133731
ΔH_f, kcal/mol:	-39.51
Dipole, Da:	3.82
IP(EA), eV:	-8.25(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[diphenylphosphorylmethyl(methyl)amino]phenyl]-(furan-2-yl)methanone

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)CC#N)NC(=O)C2=CC=CC=C2)OC

DOS

IR

Vibrations