Geometry & MOs

Info

ID:	211037
PubChem CID:	80887619
Reduced:	SN7C13H21 (1)
Stoich.:	AB7C13D21 (1)
Weight, g/mol:	309.162332
ΔH_f, kcal/mol:	71.2
Dipole, Da:	4.69
IP(EA), eV:	-8.93(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentylsulfanyl-N-ethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=NC(=NC(=N1)SC2=CC(=NN2C)C)N(C)C

DOS

IR

Vibrations