Geometry & MOs

Info

ID:	50552
PubChem CID:	12013099
Reduced:	SN3C20H29 (1)
Stoich.:	AB3C20D29 (1)
Weight, g/mol:	397.114624
ΔH_f, kcal/mol:	37.15
Dipole, Da:	2.57
IP(EA), eV:	-8.91(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dichlorophenyl)-1-thia-3,4-diazaspiro[4.11]hexadec-3-en-2-imine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N=C2N=NC3(S2)CCCCCCCCCCC3

DOS

IR

Vibrations