Geometry & MOs

Info

ID:	178023
PubChem CID:	76264790
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	404.278741
ΔH_f, kcal/mol:	-139.9
Dipole, Da:	2.6
IP(EA), eV:	-8.6(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-1-(2-methylpropyl)-5-[2-methylpropyl-[(3-propan-2-yloxyphenyl)methyl]amino]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CC=C(C=C2)NC(=O)CCC3C(NC(=O)NC3=O)C

DOS

IR

Vibrations