Geometry & MOs

Info

ID:	188811
PubChem CID:	77769779
Reduced:	O4N5C29H37 (1)
Stoich.:	A4B5C29D37 (1)
Weight, g/mol:	368.162685
ΔH_f, kcal/mol:	-134.52
Dipole, Da:	6.15
IP(EA), eV:	-9.24(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[(1-carboxy-3-methylbutyl)carbamoyl]-4-phenylbutyl]-(hydroxymethyl)-oxophosphanium

Drug info:

PubChemData

Smile

CC(C)(C)CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2COCC3=CC=CC=C3)C(=O)N

DOS

IR

Vibrations