Geometry & MOs

Info

ID:	338046
PubChem CID:	127258677
Reduced:	ClNO3C27H34 (1)
Stoich.:	ABC3D27E34 (1)
Weight, g/mol:	301.261694
ΔH_f, kcal/mol:	-141.03
Dipole, Da:	1.79
IP(EA), eV:	-8.89(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(15-hydroxy-2-methylpentadecan-2-yl) carbamate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(C3=CC=CC=C32)C(CCCCCCCCCCCC(=O)Cl)OC(=O)N

DOS

IR

Vibrations