Geometry & MOs

Info

ID:

410778

PubChem CID:

135083579

Reduced:

NOC13H15 (1)

Stoich.:

ABC13D15 (1)

Weight, g/mol:

219.125929

ΔHf, kcal/mol:

-0.57

Dipole, Da:

3.29

IP(EA), eV:

-9.52(0.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

benzyl N-[(E)-pent-2-en-2-yl]carbamate

Drug info:

PubChemData

Smile

C=C(CCCN=C=O)CC1=CC=CC=C1

DOS

IR

Vibrations