Geometry & MOs

Info

ID:	366300
PubChem CID:	127319757
Reduced:	O2N4C17H18 (1)
Stoich.:	A2B4C17D18 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-4.84
Dipole, Da:	10.43
IP(EA), eV:	-9.14(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-oxopropyl]adamantane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations