Geometry & MOs

Info

ID:	375615
PubChem CID:	134214119
Reduced:	NO2C15H27 (1)
Stoich.:	AB2C15D27 (1)
Weight, g/mol:	198.16198
ΔH_f, kcal/mol:	-117.88
Dipole, Da:	2.12
IP(EA), eV:	-9.23(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-(hydroxymethyl)-7-methyl-3-bicyclo[3.3.1]nonanyl]methanol

Drug info:

PubChemData

Smile

CC(C)(C(=O)OCCCC1CC2CCC1C2)NC

DOS

IR

Vibrations