Geometry & MOs

Info

ID:	448577
PubChem CID:	135292046
Reduced:	ON3C11H23 (1)
Stoich.:	AB3C11D23 (1)
Weight, g/mol:	364.156912
ΔH_f, kcal/mol:	0.15
Dipole, Da:	2.77
IP(EA), eV:	-9.2(1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[[3-[(2E,4Z)-hexa-2,4-dien-3-yl]-1,2,4-thiadiazol-5-yl]carbamoyl]azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CCCN(C1COC1)C2NN2C(C)(C)C

DOS

IR

Vibrations