Geometry & MOs

Info

ID:	133282
PubChem CID:	51503932
Reduced:	N3O4C18H25 (1)
Stoich.:	A3B4C18D25 (1)
Weight, g/mol:	361.179027
ΔH_f, kcal/mol:	-148.44
Dipole, Da:	4.73
IP(EA), eV:	-8.73(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-ethoxyphenyl)-N-phenyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC2=C(C=C1)OCO2)NC(=O)CN3CCC(CC3)C(=O)NC

DOS

IR

Vibrations