Geometry & MOs

Info

ID:	441060
PubChem CID:	135232964
Reduced:	OSN5C17H31 (1)
Stoich.:	ABC5D17E31 (1)
Weight, g/mol:	174.115698
ΔH_f, kcal/mol:	8.11
Dipole, Da:	3.77
IP(EA), eV:	-8.39(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1Z)-buta-1,3-dienyl]-N,5-dimethylpyridin-2-amine

Drug info:

PubChemData

Smile

C/C=C(\C=NC(C)C(C)SC(=NC=C)NNC)/N1CCC(CC1)O

DOS

IR

Vibrations