Geometry & MOs

Info

ID:	149627
PubChem CID:	53789301
Reduced:	S2O7H26C28 (1)
Stoich.:	A2B7C26D28 (1)
Weight, g/mol:	349.144471
ΔH_f, kcal/mol:	-182.73
Dipole, Da:	8.49
IP(EA), eV:	-9.62(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-N-[2-(2-chlorophenyl)ethyl]-8-methoxy-3-methyl-10-methylidene-2,9-dioxatricyclo[4.3.1.03,7]decan-4-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OCCOC

DOS

IR

Vibrations