Geometry & MOs

Info

ID:	125976
PubChem CID:	50946393
Reduced:	FON7C19H22 (1)
Stoich.:	ABC7D19E22 (1)
Weight, g/mol:	310.135114
ΔH_f, kcal/mol:	6.69
Dipole, Da:	6.31
IP(EA), eV:	-8.31(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-4-methyl-3-[methyl(methylsulfonyl)amino]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)NCCNC2=NN=C(C=C2)N3C(=CC(=N3)C)C)F

DOS

IR

Vibrations