Geometry & MOs

Info

ID:	224263
PubChem CID:	85340889
Reduced:	NO4C14H15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-106.88
Dipole, Da:	4.6
IP(EA), eV:	-9.35(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(1-phenylpent-3-en-2-yl)carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COCC(CC=O)N2C=COC2=O

DOS

IR

Vibrations