Geometry & MOs

Info

ID:	358865
PubChem CID:	127296736
Reduced:	OSN5C19H25 (1)
Stoich.:	ABC5D19E25 (1)
Weight, g/mol:	385.193632
ΔH_f, kcal/mol:	10.28
Dipole, Da:	6.21
IP(EA), eV:	-9.04(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)N3CCN4CCCCC4C3

DOS

IR

Vibrations