Geometry & MOs

Info

ID:	51929
PubChem CID:	12014699
Reduced:	OF2N2C20H22 (2)
Stoich.:	AB2C2D20E22 (2)
Weight, g/mol:	393.134124
ΔH_f, kcal/mol:	7.81
Dipole, Da:	4.48
IP(EA), eV:	-5.63(-3.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[[ethoxy(methoxy)phosphoryl]-(4-methoxyphenyl)methyl]carbamate

Drug info:

PubChemData

Smile

C1COCCN2CC3=CC=CC(=C3F)CN4CCOCCN(CC5=C(C(=CC=C5)C2)F)CC6=CC=CC(=C6F)CN1CC7=C(C(=CC=C7)C4)F

DOS

IR

Vibrations