Geometry & MOs

Info

ID:	217682
PubChem CID:	85088209
Reduced:	OC13H22 (2)
Stoich.:	AB13C22 (2)
Weight, g/mol:	390.065031
ΔH_f, kcal/mol:	-156.21
Dipole, Da:	3.18
IP(EA), eV:	-9.61(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[(3,4-dichlorophenyl)methylideneamino]-methylamino]-3-phenyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2C(C=C4C3(CCOC4)C)O)C

DOS

IR

Vibrations