Geometry & MOs

Info

ID:	360586
PubChem CID:	127301231
Reduced:	O2N5C21H29 (1)
Stoich.:	A2B5C21D29 (1)
Weight, g/mol:	383.177982
ΔH_f, kcal/mol:	-75.91
Dipole, Da:	6.39
IP(EA), eV:	-9.12(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-(4,5-dimethyl-1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)NC(=O)CN2CCC(CC2)C3=NC4=CC=CC=C4N3

DOS

IR

Vibrations