Geometry & MOs

Info

ID:	266175
PubChem CID:	103558691
Reduced:	ClON4C9H13 (1)
Stoich.:	ABC4D9E13 (1)
Weight, g/mol:	226.088832
ΔH_f, kcal/mol:	-1.18
Dipole, Da:	3.01
IP(EA), eV:	-9.91(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-[(1-methoxycyclobutyl)methyl]-1H-1,3,5-triazine-4-thione

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=NC(=NC(=N2)Cl)N

DOS

IR

Vibrations