Geometry & MOs

Info

ID:	263990
PubChem CID:	103413077
Reduced:	ClNO2C12H24 (1)
Stoich.:	ABC2D12E24 (1)
Weight, g/mol:	313.171165
ΔH_f, kcal/mol:	-100.88
Dipole, Da:	3.07
IP(EA), eV:	-8.92(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[[4-[3-(2-methoxyethoxy)propylsulfanyl]phenyl]methyl]ethanamine

Drug info:

PubChemData

Smile

CN(CCCOCCOC)CC1CC(C1)Cl

DOS

IR

Vibrations