Geometry & MOs

Info

ID:	50550
PubChem CID:	12013097
Reduced:	SN3C20H29 (1)
Stoich.:	AB3C20D29 (1)
Weight, g/mol:	379.208219
ΔH_f, kcal/mol:	34.82
Dipole, Da:	1.23
IP(EA), eV:	-8.74(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-naphthalen-2-yl-1-thia-3,4-diazaspiro[4.11]hexadec-3-en-2-imine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N=C2N=NC3(S2)CCCCCCCCCCC3

DOS

IR

Vibrations