Geometry & MOs

Info

ID:	289764
PubChem CID:	104372962
Reduced:	FSO2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-108.5
Dipole, Da:	2.96
IP(EA), eV:	-9.13(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-methoxy-5-methylphenyl)-2-methylcyclopropyl]methanamine

Drug info:

PubChemData

Smile

CCC1CC1(C(=O)O)SC2=CC=C(C=C2)F

DOS

IR

Vibrations