Geometry & MOs

Info

ID:	418901
PubChem CID:	135107094
Reduced:	ON4F6C18H20 (1)
Stoich.:	AB4C6D18E20 (1)
Weight, g/mol:	382.119654
ΔH_f, kcal/mol:	-316.86
Dipole, Da:	5.14
IP(EA), eV:	-9.1(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[[5-(3-chlorophenyl)furan-2-yl]methylamino]pyrazin-2-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=NC=C(N1)CN(CCN(C)C)C(=O)C2=C(C=C(C=C2)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations