Geometry & MOs

Info

ID:	263873
PubChem CID:	103404067
Reduced:	ClNS2O3H12C13 (1)
Stoich.:	ABC2D3E12F13 (1)
Weight, g/mol:	297.157623
ΔH_f, kcal/mol:	-92.54
Dipole, Da:	5.07
IP(EA), eV:	-8.68(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyethoxy)propyl 2-amino-6-ethoxybenzoate

Drug info:

PubChemData

Smile

CC1=CSC(=C1NC(=O)C2=C(C(=CS2)C)Cl)C(=O)OC

DOS

IR

Vibrations