Geometry & MOs

Info

ID:	186082
PubChem CID:	77388496
Reduced:	N4O5C26H32 (1)
Stoich.:	A4B5C26D32 (1)
Weight, g/mol:	501.141511
ΔH_f, kcal/mol:	-195.82
Dipole, Da:	5.95
IP(EA), eV:	-8.55(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chlorophenyl)methyl]-3-[2-(2-hydroxyethoxy)ethyl]-6-[4-(1,2-oxazol-3-yloxy)anilino]-1,3,5-triazinane-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)CCCN1C(=O)NC(N(C1=O)CC2=CC=C(C=C2)C)NC3=CC4=C(C=C3)OC(C4)C

DOS

IR

Vibrations