Geometry & MOs

Info

ID:	240165
PubChem CID:	93576440
Reduced:	N2O2C11H16 (2)
Stoich.:	A2B2C11D16 (2)
Weight, g/mol:	440.161518
ΔH_f, kcal/mol:	-151.38
Dipole, Da:	5.13
IP(EA), eV:	-9.14(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[3-[1-[2-(2-chloroanilino)-2-oxoethyl]benzimidazol-2-yl]propyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CCOCCCNC(=O)CN1C2=CC=CC=C2N=C1CCCNC(=O)[C@@H]3CCCO3

DOS

IR

Vibrations