Geometry & MOs

Info

ID:	349243
PubChem CID:	127274969
Reduced:	SO2N5C15H19 (1)
Stoich.:	AB2C5D15E19 (1)
Weight, g/mol:	387.139882
ΔH_f, kcal/mol:	-12.47
Dipole, Da:	2.52
IP(EA), eV:	-9.06(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(1,3-thiazol-4-ylmethyl)-1,4-diazepane-1-carbonyl]piperidine-1-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)CN2C=CC=NC2=O)CC3=CSC=N3

DOS

IR

Vibrations