Geometry & MOs

Info

ID:	411553
PubChem CID:	135084385
Reduced:	C13H16 (1)
Stoich.:	A13B16 (1)
Weight, g/mol:	167.094629
ΔH_f, kcal/mol:	37.33
Dipole, Da:	0.88
IP(EA), eV:	-9.19(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-but-3-ynyl-N-prop-2-enylcarbamate

Drug info:

PubChemData

Smile

CC1(C(C1C2=CC=CC=C2)C=C)C

DOS

IR

Vibrations