Geometry & MOs

Info

ID:	224539
PubChem CID:	85344632
Reduced:	SN3H7C10 (1)
Stoich.:	AB3C7D10 (1)
Weight, g/mol:	203.1674
ΔH_f, kcal/mol:	140.52
Dipole, Da:	4.05
IP(EA), eV:	-9.06(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,8-dimethyl-4-methylidene-2,3,5,6,7,8a-hexahydro-1H-azulene-3a-carbonitrile

Drug info:

PubChemData

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C#CCSC1=NC2=CC=CC=C2N=N1

DOS

IR

Vibrations