Geometry & MOs

Info

ID:	243316
PubChem CID:	99218294
Reduced:	SN3O4C17H25 (1)
Stoich.:	AB3C4D17E25 (1)
Weight, g/mol:	444.189651
ΔH_f, kcal/mol:	-171.0
Dipole, Da:	7.36
IP(EA), eV:	-9.56(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3,5-dimethoxyphenyl)methyl-[3-[(2-methoxybenzoyl)amino]propanoyl]amino]acetate

Drug info:

PubChemData

Smile

CCN1C[C@H](CC1=O)C(=O)NC2=CC=CC=C2S(=O)(=O)NC(C)(C)C

DOS

IR

Vibrations