Geometry & MOs

Info

ID:	236236
PubChem CID:	92711991
Reduced:	OF3N3C18H20 (1)
Stoich.:	AB3C3D18E20 (1)
Weight, g/mol:	375.09462
ΔH_f, kcal/mol:	-165.84
Dipole, Da:	3.77
IP(EA), eV:	-8.88(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-(4-bromo-3-methylphenyl)-1-propyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CCC[C@H]1C2=CC=CN2CCN1C(=O)NC3=CC=CC(=C3)C(F)(F)F

DOS

IR

Vibrations