Geometry & MOs

Info

ID:	357293
PubChem CID:	127293926
Reduced:	OSN5C20H27 (1)
Stoich.:	ABC5D20E27 (1)
Weight, g/mol:	399.209282
ΔH_f, kcal/mol:	11.3
Dipole, Da:	5.85
IP(EA), eV:	-9.17(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(2-phenylpropan-2-yl)-1,3,4-thiadiazol-2-yl]-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)C2=NN=C(S2)NC(=O)N3CCN4CCCCC4C3

DOS

IR

Vibrations