Geometry & MOs

Info

ID:	144597
PubChem CID:	53387581
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	154.135765
ΔH_f, kcal/mol:	-151.83
Dipole, Da:	1.04
IP(EA), eV:	-9.11(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-2-ethyl-5-methylidenecycloheptan-1-ol

Drug info:

PubChemData

Smile

C[C@@H](CC1=CC(=CC=C1)O)N(C)C(=O)OC(C)(C)C

DOS

IR

Vibrations