Geometry & MOs

Info

ID:	243321
PubChem CID:	99218316
Reduced:	NO5C22H31 (1)
Stoich.:	AB5C22D31 (1)
Weight, g/mol:	455.16925
ΔH_f, kcal/mol:	-191.66
Dipole, Da:	4.54
IP(EA), eV:	-8.75(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3,5-dimethoxyphenyl)methyl-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoyl]amino]acetate

Drug info:

PubChemData

Smile

CC(=C[C@H]1[C@@H](C1(C)C)C(=O)N(CC2=CC(=CC(=C2)OC)OC)CC(=O)OC)C

DOS

IR

Vibrations