Geometry & MOs

Info

ID:	387270
PubChem CID:	134984678
Reduced:	ClNSO3C16H16 (1)
Stoich.:	ABCD3E16F16 (1)
Weight, g/mol:	379.189592
ΔH_f, kcal/mol:	-50.63
Dipole, Da:	3.64
IP(EA), eV:	-9.35(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,5S)-5-(3,4-dimethoxyphenyl)-3-(imidazol-1-ylmethyl)-2-methyl-3-phenyl-1,2-oxazolidine

Drug info:

PubChemData

Smile

C1[C@H](N(O[C@@H]1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CCl

DOS

IR

Vibrations