Geometry & MOs

Info

ID:	138973
PubChem CID:	52453112
Reduced:	SN3O3C22H25 (1)
Stoich.:	AB3C3D22E25 (1)
Weight, g/mol:	425.231456
ΔH_f, kcal/mol:	-93.85
Dipole, Da:	7.2
IP(EA), eV:	-8.78(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-3-[2-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]-5-methyl-5-(2-methylpropyl)imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC[C@H]1CCCCN1C(=O)CN2C3=C(C(=O)N(C2=O)C4=CC=CC(=C4)C)SC=C3

DOS

IR

Vibrations