Geometry & MOs

Info

ID:	1455
PubChem CID:	4492
Reduced:	N4O9C22H28 (1)
Stoich.:	A4B9C22D28 (1)
Weight, g/mol:	492.185629
ΔH_f, kcal/mol:	-350.5
Dipole, Da:	6.65
IP(EA), eV:	-9.76(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-amino-4-(5-hydroxypyridin-2-yl)-3-methylpentanoyl]amino]-2-[5-(2,4-dioxopyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]acetic acid

Drug info:

PubChemData

Smile

CC(C1=NC=C(C=C1)O)C(C)C(C(=O)NC(C2C(C(C(O2)N3C=CC(=O)CC3=O)O)O)C(=O)O)N

DOS

IR

Vibrations