Geometry & MOs

Info

ID:	355139
PubChem CID:	127288071
Reduced:	O3N6C17H26 (1)
Stoich.:	A3B6C17D26 (1)
Weight, g/mol:	390.299476
ΔH_f, kcal/mol:	-99.23
Dipole, Da:	5.26
IP(EA), eV:	-8.78(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-adamantylcarbamoylamino)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN1CCC(CC1)N(C)C(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

DOS

IR

Vibrations