Geometry & MOs

Info

ID:	5519
PubChem CID:	13270
Reduced:	SN5C10H19 (1)
Stoich.:	AB5C10D19 (1)
Weight, g/mol:	241.136117
ΔH_f, kcal/mol:	17.46
Dipole, Da:	3.86
IP(EA), eV:	-8.68(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-butan-2-yl-4-N-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCC(C)NC1=NC(=NC(=N1)NCC)SC

DOS

IR

Vibrations