Geometry & MOs

Info

ID:	219224
PubChem CID:	85096596
Reduced:	NSO8C22H27 (1)
Stoich.:	ABC8D22E27 (1)
Weight, g/mol:	466.165759
ΔH_f, kcal/mol:	-266.75
Dipole, Da:	7.91
IP(EA), eV:	-8.45(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-(diphenylphosphorylamino)-3-(4-hydroxyphenyl)propanoyl]amino]propanoate

Drug info:

PubChemData

Smile

CC(C(=O)O)NC1=C(C=CC(=C1)CS(=O)(=O)C=CC2=C(C=C(C=C2OC)OC)OC)OC

DOS

IR

Vibrations