Geometry & MOs

Info

ID:	124188
PubChem CID:	50874077
Reduced:	ClNO2C9H14 (1)
Stoich.:	ABC2D9E14 (1)
Weight, g/mol:	409.166251
ΔH_f, kcal/mol:	-112.75
Dipole, Da:	2.76
IP(EA), eV:	-9.72(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)-4-fluorobenzohydrazide

Drug info:

PubChemData

Smile

CC(C)CN1CC(CC1=O)C(=O)Cl

DOS

IR

Vibrations