Geometry & MOs

Info

ID:	401394
PubChem CID:	135051146
Reduced:	NSO5C16H19 (1)
Stoich.:	ABC5D16E19 (1)
Weight, g/mol:	368.159221
ΔH_f, kcal/mol:	-153.58
Dipole, Da:	4.36
IP(EA), eV:	-8.91(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-[1-[2,4-bis(tert-butylsulfanyl)-5-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine

Drug info:

PubChemData

Smile

COC(CC(=O)CC1=CN(C=C1)S(=O)(=O)C2=CC=CC=C2)OC

DOS

IR

Vibrations