Geometry & MOs

Info

ID:	293637
PubChem CID:	117394697
Reduced:	N2C17H24 (1)
Stoich.:	A2B17C24 (1)
Weight, g/mol:	256.050237
ΔH_f, kcal/mol:	32.39
Dipole, Da:	2.35
IP(EA), eV:	-8.84(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-6-hydroxy-5-methoxy-3-methylphenyl)cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC1N2CC3=C(C2)C=C(C=C3)CC4CCNCC4

DOS

IR

Vibrations