Geometry & MOs

Info

ID:	256379
PubChem CID:	103138872
Reduced:	ClNOC16H24 (1)
Stoich.:	ABCD16E24 (1)
Weight, g/mol:	311.165207
ΔH_f, kcal/mol:	-61.18
Dipole, Da:	2.43
IP(EA), eV:	-8.68(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-N-(2-methoxyethyl)-3-(5-methyloxolan-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

CCNCC(CC1CCC(O1)C)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations