Geometry & MOs

Info

ID:	206915
PubChem CID:	80321598
Reduced:	SO2N3C11H15 (1)
Stoich.:	AB2C3D11E15 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-70.01
Dipole, Da:	2.46
IP(EA), eV:	-8.99(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-3-propan-2-yl-1,4-diazepane-2,5-dione

Drug info:

PubChemData

Smile

CC1C(=O)N(CC(=O)N1)CC2=NC(=C(S2)C)C

DOS

IR

Vibrations