Geometry & MOs

Info

ID:	81051
PubChem CID:	49854291
Reduced:	ON3C15H29 (1)
Stoich.:	AB3C15D29 (1)
Weight, g/mol:	267.231063
ΔH_f, kcal/mol:	-83.5
Dipole, Da:	2.21
IP(EA), eV:	-8.96(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperazin-1-yl-N-[(1R,5R)-3,3,5-trimethylcyclohexyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CC(C1)(C)C)NC(=O)CN2CCNCC2

DOS

IR

Vibrations