Geometry & MOs

Info

ID:	407163
PubChem CID:	135079487
Reduced:	OSN2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	327.219829
ΔH_f, kcal/mol:	16.2
Dipole, Da:	3.7
IP(EA), eV:	-8.48(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(2-cyclopropylprop-2-enyl)-N-(1-phenylbut-3-en-2-yl)carbamate

Drug info:

PubChemData

Smile

C/C(=N\[S@](=O)C(C)(C)C)/C1=CC=C(C=C1)C#N

DOS

IR

Vibrations