Geometry & MOs

Info

ID:	263871
PubChem CID:	103403788
Reduced:	ClOSN3C11H12 (1)
Stoich.:	ABCD3E11F12 (1)
Weight, g/mol:	296.173607
ΔH_f, kcal/mol:	11.22
Dipole, Da:	6.69
IP(EA), eV:	-9.29(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyethoxy)propyl 5-amino-2-(dimethylamino)benzoate

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(=O)N2CCNCC2C#N

DOS

IR

Vibrations