Geometry & MOs

Info

ID:	349416
PubChem CID:	127275203
Reduced:	N3O3C22H33 (1)
Stoich.:	A3B3C22D33 (1)
Weight, g/mol:	389.173942
ΔH_f, kcal/mol:	-134.76
Dipole, Da:	1.92
IP(EA), eV:	-9.0(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5,5-dimethyl-2-phenylmorpholin-4-yl)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCC1)NC(=O)CN2CC(OCC2(C)C)C3=CC=CC=C3

DOS

IR

Vibrations