Geometry & MOs

Info

ID:	380640
PubChem CID:	134971152
Reduced:	OC8H10 (2)
Stoich.:	AB8C10 (2)
Weight, g/mol:	384.171893
ΔH_f, kcal/mol:	-60.27
Dipole, Da:	1.67
IP(EA), eV:	-9.31(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(Z,2R,5R)-5-hydroxy-6-[(4-methylphenyl)sulfonylamino]hex-3-en-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(=CCCC1=CCC2C(C1)C(=O)C=CC2=O)C

DOS

IR

Vibrations