Geometry & MOs

Info

ID:	197208
PubChem CID:	78938241
Reduced:	ClNOC15H22 (1)
Stoich.:	ABCD15E22 (1)
Weight, g/mol:	270.149891
ΔH_f, kcal/mol:	-57.68
Dipole, Da:	3.63
IP(EA), eV:	-8.74(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[3-chloro-4-[2-(diethylamino)ethoxy]phenyl]ethanamine

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=C(C=C1)OC2CCCCCC2)Cl)N

DOS

IR

Vibrations