Geometry & MOs

Info

ID:	60539
PubChem CID:	26697156
Reduced:	O2N3H17C18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	369.241627
ΔH_f, kcal/mol:	-24.88
Dipole, Da:	1.65
IP(EA), eV:	-8.78(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-adamantylcarbamoylamino)-N-(4-ethylphenyl)propanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

DOS

IR

Vibrations