Geometry & MOs

Info

ID:	240163
PubChem CID:	93576435
Reduced:	SO3N4C22H26 (1)
Stoich.:	AB3C4D22E26 (1)
Weight, g/mol:	410.195405
ΔH_f, kcal/mol:	-66.98
Dipole, Da:	2.96
IP(EA), eV:	-9.12(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[3-[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzimidazol-2-yl]propyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)C(=O)NCCCC2=NC3=CC=CC=C3N2CC(=O)NCC4=CC=CS4

DOS

IR

Vibrations