Geometry & MOs

Info

ID:	233999
PubChem CID:	92297507
Reduced:	O2N3C24H27 (1)
Stoich.:	A2B3C24D27 (1)
Weight, g/mol:	389.210327
ΔH_f, kcal/mol:	-22.93
Dipole, Da:	2.0
IP(EA), eV:	-8.41(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)N2CCN3C=CC=C3[C@@H]2C4=C(C=C(C=C4)C)C

DOS

IR

Vibrations