Geometry & MOs

Info

ID:	210245
PubChem CID:	80780451
Reduced:	N3O3C12H19 (1)
Stoich.:	A3B3C12D19 (1)
Weight, g/mol:	293.221561
ΔH_f, kcal/mol:	-54.23
Dipole, Da:	3.56
IP(EA), eV:	-8.47(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,4-N-dimethyl-2-N-(4-methylcyclohexyl)-6-propoxy-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCC(CO)NC1=CC=CC(=C1[N+](=O)[O-])NCC

DOS

IR

Vibrations