Geometry & MOs

Info

ID:	297922
PubChem CID:	117636475
Reduced:	SO3N6H26C28 (1)
Stoich.:	AB3C6D26E28 (1)
Weight, g/mol:	382.121195
ΔH_f, kcal/mol:	32.75
Dipole, Da:	6.53
IP(EA), eV:	-8.16(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-morpholin-4-yl-3-phenyl-1-(4-thiophen-2-yl-1,3,5-triazin-2-yl)urea

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)C2=CSC=C2)CC(=O)N3CCC4=C3C=CC(=C4)NC5=NC=NC6=CC(=C(C=C65)OC)OC

DOS

IR

Vibrations