Geometry & MOs

Info

ID:	240159
PubChem CID:	93576412
Reduced:	NOC5H7 (4)
Stoich.:	ABC5D7 (4)
Weight, g/mol:	386.231791
ΔH_f, kcal/mol:	-141.98
Dipole, Da:	2.31
IP(EA), eV:	-8.96(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COCC(=O)NCCCC1=NC2=CC=CC=C2N1CC(=O)NC[C@@H]3CCCO3

DOS

IR

Vibrations