Geometry & MOs

Info

ID:	199029
PubChem CID:	79190312
Reduced:	ClFNC14H19 (1)
Stoich.:	ABCD14E19 (1)
Weight, g/mol:	206.13068
ΔH_f, kcal/mol:	-47.98
Dipole, Da:	2.36
IP(EA), eV:	-8.7(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxy-3-methylphenyl)-3-methylbut-2-en-1-ol

Drug info:

PubChemData

Smile

CCNC(CC1=C(C=CC=C1Cl)F)C=C(C)C

DOS

IR

Vibrations