Geometry & MOs

Info

ID:	220354
PubChem CID:	85177327
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-85.15
Dipole, Da:	3.32
IP(EA), eV:	-8.67(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(2-phenylbut-2-enyl)carbamate

Drug info:

PubChemData

Smile

CC1=C2C3C(COC2=C(C=C1)C)CON3C(=O)C

DOS

IR

Vibrations