Geometry & MOs

Info

ID:	340041
PubChem CID:	127262050
Reduced:	PN4O6C11H23 (1)
Stoich.:	AB4C6D11E23 (1)
Weight, g/mol:	366.166822
ΔH_f, kcal/mol:	-333.98
Dipole, Da:	5.09
IP(EA), eV:	-9.62(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]-[(2S)-2-[[2-(propylamino)acetyl]amino]propanoyl]amino]ethyl]phosphonic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N([C@@H](C)C(=O)N)[C@H](C)P(=O)(O)O)NC(=O)CNC

DOS

IR

Vibrations