Geometry & MOs

Info

ID:	354284
PubChem CID:	127286248
Reduced:	O2N5C21H29 (1)
Stoich.:	A2B5C21D29 (1)
Weight, g/mol:	369.216475
ΔH_f, kcal/mol:	-22.13
Dipole, Da:	7.34
IP(EA), eV:	-8.98(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)C2=CC=C(C=C2)NC(=O)N3CCCC3CN4CCCC4

DOS

IR

Vibrations