Geometry & MOs

Info

ID:	72565
PubChem CID:	48416311
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	413.195071
ΔH_f, kcal/mol:	-122.0
Dipole, Da:	2.66
IP(EA), eV:	-8.77(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CC(=O)N2CCCC(C2)N3CCNC3=O)OC

DOS

IR

Vibrations