Geometry & MOs

Info

ID:	178602
PubChem CID:	76355003
Reduced:	N4O4C19H24 (1)
Stoich.:	A4B4C19D24 (1)
Weight, g/mol:	493.290034
ΔH_f, kcal/mol:	-76.86
Dipole, Da:	3.73
IP(EA), eV:	-8.9(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[6-amino-1-(2-methylpropyl)-2,4-dioxo-1,3-diazinan-5-yl]-(2-methylpropyl)amino]-N-(3,4,5-trimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)CN(C)C(=O)C(C)NC(=O)C=CC2=CC=C(C=C2)OC

DOS

IR

Vibrations