Geometry & MOs

Info

ID:	155062
PubChem CID:	56320632
Reduced:	SN4O5C18H30 (1)
Stoich.:	AB4C5D18E30 (1)
Weight, g/mol:	425.125671
ΔH_f, kcal/mol:	-218.0
Dipole, Da:	8.77
IP(EA), eV:	-9.76(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 3-[(1,2-dimethylimidazol-4-yl)sulfonylamino]propanoate

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCCC(=O)OC(C)C(=O)NCC2CCCCC2

DOS

IR

Vibrations