Geometry & MOs

Info

ID:	355489
PubChem CID:	127288552
Reduced:	O2N3C16H27 (1)
Stoich.:	A2B3C16D27 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	-109.45
Dipole, Da:	5.95
IP(EA), eV:	-8.55(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-oxoethyl]-N-methyl-2-pyrazol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC(=O)NC1(CCCCC1)C(=O)N2CCN3CCCC3C2

DOS

IR

Vibrations