Geometry & MOs

Info

ID:	169893
PubChem CID:	75164048
Reduced:	O4C6H7 (2)
Stoich.:	A4B6C7 (2)
Weight, g/mol:	584.238333
ΔH_f, kcal/mol:	-307.27
Dipole, Da:	0.23
IP(EA), eV:	-11.34(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[[4-methoxy-6-[2-[(1-oxo-1-phenylmethoxypropan-2-yl)carbamoyl]anilino]-1,3,5-triazin-2-yl]amino]propanoate

Drug info:

PubChemData

Smile

CC(OC(=O)C=CC(=O)OC)OC(=O)C=CC(=O)OC

DOS

IR

Vibrations