Geometry & MOs

Info

ID:	440773
PubChem CID:	135231404
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	129.061221
ΔH_f, kcal/mol:	-29.08
Dipole, Da:	1.92
IP(EA), eV:	-10.58(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-methylidene-4-methylsulfanylbut-3-en-1-amine

Drug info:

PubChemData

Smile

C1CCCCC(CCC1)C2=NOC(=C2)C=O

DOS

IR

Vibrations