Geometry & MOs

Info

ID:	130232
PubChem CID:	51075333
Reduced:	O2N4C17H20 (1)
Stoich.:	A2B4C17D20 (1)
Weight, g/mol:	326.13789
ΔH_f, kcal/mol:	-46.06
Dipole, Da:	3.79
IP(EA), eV:	-8.8(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(pyrazine-2-carbonylamino)-4-pyrrolidin-1-ylbenzoate

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)C2=CC=CN2)C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations