Geometry & MOs

Info

ID:	404234
PubChem CID:	135065510
Reduced:	PO2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	419.18616
ΔH_f, kcal/mol:	-78.37
Dipole, Da:	4.21
IP(EA), eV:	-9.1(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[1-[ethoxy(phenyl)phosphoryl]-2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)P(=O)(C2=CC=CC3=CC=CC=C32)O)C

DOS

IR

Vibrations