Geometry & MOs

Info

ID:	385161
PubChem CID:	134978423
Reduced:	NSSnO3C29H51 (1)
Stoich.:	ABCD3E29F51 (1)
Weight, g/mol:	178.172151
ΔH_f, kcal/mol:	-128.7
Dipole, Da:	7.62
IP(EA), eV:	-8.88(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methylidenedodec-6-yne

Drug info:

PubChemData

Smile

CCCC[Sn](CCCC)(CCCC)C=C=C[C@H](C(C)C)NS(=O)(=O)C1=C(C(=C(C=C1C)OC)C)C

DOS

IR

Vibrations