Geometry & MOs

Info

ID:	340023
PubChem CID:	127262032
Reduced:	O4N5C16H31 (1)
Stoich.:	A4B5C16D31 (1)
Weight, g/mol:	338.135521
ΔH_f, kcal/mol:	-221.15
Dipole, Da:	5.68
IP(EA), eV:	-9.46(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCN([C@@H](C)C(=O)N)C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)N

DOS

IR

Vibrations