Geometry & MOs

Info

ID:	240181
PubChem CID:	93576520
Reduced:	N2O2C11H13 (2)
Stoich.:	A2B2C11D13 (2)
Weight, g/mol:	406.236876
ΔH_f, kcal/mol:	-101.33
Dipole, Da:	3.37
IP(EA), eV:	-8.9(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]benzimidazol-2-yl]propyl]-2-methylbenzamide

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CNC(=O)CN2C3=CC=CC=C3N=C2CCCNC(=O)C4=CC=CO4

DOS

IR

Vibrations