Geometry & MOs

Info

ID:	401327
PubChem CID:	135050969
Reduced:	PN2O2H25C30 (1)
Stoich.:	AB2C2D25E30 (1)
Weight, g/mol:	350.147786
ΔH_f, kcal/mol:	57.47
Dipole, Da:	7.49
IP(EA), eV:	-7.67(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-oxo-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=CC=CC=C2N=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C

DOS

IR

Vibrations