Geometry & MOs

Info

ID:	205300
PubChem CID:	80082628
Reduced:	BrNOC15H24 (1)
Stoich.:	ABCD15E24 (1)
Weight, g/mol:	317.13132
ΔH_f, kcal/mol:	-53.43
Dipole, Da:	3.82
IP(EA), eV:	-8.78(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dichlorophenyl)-3-ethyl-N-(2-methoxyethyl)pentan-1-amine

Drug info:

PubChemData

Smile

CCC(CC)OC1=C(C=C(C=C1)Br)C(C)NCC

DOS

IR

Vibrations