Geometry & MOs

Info

ID:	357870
PubChem CID:	127295370
Reduced:	SO2N5C18H29 (1)
Stoich.:	AB2C5D18E29 (1)
Weight, g/mol:	390.208947
ΔH_f, kcal/mol:	-64.14
Dipole, Da:	2.61
IP(EA), eV:	-8.75(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyclopentylacetyl)-1,4-diazepan-1-yl]-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C1CCCCC1)C2=NC=CS2)N3CCN(CC3)CC(=O)N

DOS

IR

Vibrations