Geometry & MOs

Info

ID:	292842
PubChem CID:	117360703
Reduced:	NOC16H21 (1)
Stoich.:	ABC16D21 (1)
Weight, g/mol:	243.162314
ΔH_f, kcal/mol:	-30.53
Dipole, Da:	3.4
IP(EA), eV:	-9.06(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethyl-1-benzofuran-5-yl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)C2(CCC2)N=C=O)C(C)C

DOS

IR

Vibrations