Geometry & MOs

Info

ID:	242247
PubChem CID:	96081252
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	341.148789
ΔH_f, kcal/mol:	-103.99
Dipole, Da:	1.34
IP(EA), eV:	-9.11(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[2-[(2S)-2-(5-methyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-2-oxoethyl]benzimidazol-2-one

Drug info:

PubChemData

Smile

CC[C@H](C)[C@H](C(=O)N)NC(=O)CCCC1=NC=C(O1)C2=CC=CC=C2

DOS

IR

Vibrations