Geometry & MOs

Info

ID:	210867
PubChem CID:	80864934
Reduced:	N3O4H13C14 (1)
Stoich.:	A3B4C13D14 (1)
Weight, g/mol:	308.104003
ΔH_f, kcal/mol:	-36.82
Dipole, Da:	10.29
IP(EA), eV:	-9.35(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chlorophenoxy)-N-ethyl-6-propoxy-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CNC1=C(C(=CC=C1)OC2=CC=CC=C2C(=O)N)[N+](=O)[O-]

DOS

IR

Vibrations