Geometry & MOs

Info

ID:	440184
PubChem CID:	135230094
Reduced:	ON2S2C11H16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	182.178299
ΔH_f, kcal/mol:	-1.54
Dipole, Da:	4.46
IP(EA), eV:	-9.09(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-[(Z)-butylideneamino]-N-propan-2-ylbut-2-en-2-amine

Drug info:

PubChemData

Smile

CCNCC(CSSC1=CC=CC=N1)C=O

DOS

IR

Vibrations