Geometry & MOs

Info

ID:	33658
PubChem CID:	7887359
Reduced:	OS2N3C21H25 (1)
Stoich.:	AB2C3D21E25 (1)
Weight, g/mol:	401.104542
ΔH_f, kcal/mol:	-5.45
Dipole, Da:	3.34
IP(EA), eV:	-8.9(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)amino]-2-oxoethyl] 1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(C)C)NC(=O)[C@@H](C)SC2=NC=NC3=C2C(=C(S3)C)C

DOS

IR

Vibrations