Geometry & MOs

Info

ID:	236246
PubChem CID:	92712021
Reduced:	O2N3C23H25 (1)
Stoich.:	A2B3C23D25 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-12.23
Dipole, Da:	2.58
IP(EA), eV:	-8.71(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-(2,5-dimethoxyphenyl)-1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CNC(=O)N2CCN3C=CC=C3[C@@H]2CC4=CC=CC=C4

DOS

IR

Vibrations