Geometry & MOs

Info

ID:	406884
PubChem CID:	135078828
Reduced:	NSO2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	190.135765
ΔH_f, kcal/mol:	42.0
Dipole, Da:	6.65
IP(EA), eV:	-9.21(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-4-methoxy-4-methylpent-1-enyl]benzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC#C)C#C

DOS

IR

Vibrations