Geometry & MOs

Info

ID:	137700
PubChem CID:	52246601
Reduced:	ON3C18H27 (1)
Stoich.:	AB3C18D27 (1)
Weight, g/mol:	301.215413
ΔH_f, kcal/mol:	-50.2
Dipole, Da:	2.4
IP(EA), eV:	-9.63(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[2-(1-adamantyl)ethyl]-2-imidazol-1-ylpropanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCCC12CC3CC(C1)CC(C3)C2)N4C=CN=C4

DOS

IR

Vibrations