Geometry & MOs

Info

ID:	382802
PubChem CID:	134974161
Reduced:	N3O5C14H17 (1)
Stoich.:	A3B5C14D17 (1)
Weight, g/mol:	235.103085
ΔH_f, kcal/mol:	-111.42
Dipole, Da:	1.45
IP(EA), eV:	-9.14(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexen-1-ylimino-methyl-oxo-phenyl-lambda6-sulfane

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2OCC3[C@H](O2)C(C(CO3)N=[N+]=[N-])O

DOS

IR

Vibrations