Geometry & MOs

Info

ID:	240164
PubChem CID:	93576436
Reduced:	N2O2C11H13 (2)
Stoich.:	A2B2C11D13 (2)
Weight, g/mol:	416.242356
ΔH_f, kcal/mol:	-104.28
Dipole, Da:	3.7
IP(EA), eV:	-9.13(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[3-[1-[2-(3-ethoxypropylamino)-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=CO4

DOS

IR

Vibrations