Geometry & MOs

Info

ID:	246037
PubChem CID:	103036872
Reduced:	NO2C18H31 (1)
Stoich.:	AB2C18D31 (1)
Weight, g/mol:	313.180857
ΔH_f, kcal/mol:	-98.76
Dipole, Da:	1.07
IP(EA), eV:	-8.66(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)-5-methylhexan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CCC(C)(C)OC)CNCCOC

DOS

IR

Vibrations