Geometry & MOs

Info

ID:	363817
PubChem CID:	127313474
Reduced:	O3N4C20H34 (1)
Stoich.:	A3B4C20D34 (1)
Weight, g/mol:	373.272927
ΔH_f, kcal/mol:	-155.65
Dipole, Da:	3.08
IP(EA), eV:	-8.74(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]adamantane-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)N1CC(CC1=O)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations