Geometry & MOs

Info

ID:	346213
PubChem CID:	127270704
Reduced:	N3O5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	367.171834
ΔH_f, kcal/mol:	-197.4
Dipole, Da:	1.87
IP(EA), eV:	-8.38(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]adamantane-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1CC(CC1=O)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations