Geometry & MOs

Info

ID:	418758
PubChem CID:	135106713
Reduced:	N3O8C28H33 (1)
Stoich.:	A3B8C28D33 (1)
Weight, g/mol:	368.148455
ΔH_f, kcal/mol:	-193.97
Dipole, Da:	4.03
IP(EA), eV:	-8.15(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(3S,4R)-3-hydroxy-4-(quinolin-2-ylmethyl)pyrrolidin-1-yl]-2-oxoethyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C=C2C3C4=CC=C(C=C4)OCCOCCN(CC(=O)N3CCC2=C1)C(=O)CN5CCOC5=O)OC

DOS

IR

Vibrations