Geometry & MOs

Info

ID:	212096
PubChem CID:	81059492
Reduced:	FNSO5C12H16 (1)
Stoich.:	ABCD5E12F16 (1)
Weight, g/mol:	280.215078
ΔH_f, kcal/mol:	-230.59
Dipole, Da:	6.88
IP(EA), eV:	-9.95(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-N-methyl-1-(4-propan-2-yloxyphenyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)O

DOS

IR

Vibrations