Geometry & MOs

Info

ID:	392962
PubChem CID:	135018706
Reduced:	NP2O4C16H19 (1)
Stoich.:	AB2C4D16E19 (1)
Weight, g/mol:	332.038627
ΔH_f, kcal/mol:	-198.18
Dipole, Da:	6.57
IP(EA), eV:	-9.19(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-4-(2-chlorophenyl)-1-(4-methylphenyl)-3-nitroazetidine-2-thione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(NC(C2=CC=C(C=C2)C)[P+](=O)O)[P+](=O)O

DOS

IR

Vibrations