Geometry & MOs

Info

ID:	402717
PubChem CID:	135057007
Reduced:	N2S2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	195.100777
ΔH_f, kcal/mol:	58.15
Dipole, Da:	3.15
IP(EA), eV:	-8.4(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-but-2-enyl]-4,6-dimethoxy-1,3,5-triazine

Drug info:

PubChemData

Smile

C1CCC(=NSC2=NC3=CC=CC=C3S2)CC1

DOS

IR

Vibrations