Geometry & MOs

Info

ID:	338043
PubChem CID:	127258674
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-98.07
Dipole, Da:	2.1
IP(EA), eV:	-9.31(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-phenyl-2-propylpent-4-enyl) carbamate

Drug info:

PubChemData

Smile

CC(CC(C)(C)OC(=O)N)C1=CC=CC=C1

DOS

IR

Vibrations