Geometry & MOs

Info

ID:	68543
PubChem CID:	46508614
Reduced:	O3N4C28H30 (1)
Stoich.:	A3B4C28D30 (1)
Weight, g/mol:	374.15902
ΔH_f, kcal/mol:	-37.65
Dipole, Da:	6.63
IP(EA), eV:	-9.01(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-5-[2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)CC(=O)NC3=CC=CC(=C3)C(=O)NC4CC4

DOS

IR

Vibrations