Geometry & MOs

Info

ID:	171700
PubChem CID:	75414307
Reduced:	NSO7C22H23 (1)
Stoich.:	ABC7D22E23 (1)
Weight, g/mol:	236.116092
ΔH_f, kcal/mol:	-212.96
Dipole, Da:	4.06
IP(EA), eV:	-8.69(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-(dimethylcarbamoyl)anilino]acetate

Drug info:

PubChemData

Smile

CC(C1=CC2=C(O1)C(=CC=C2)OC)NC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations