Geometry & MOs

Info

ID:	236291
PubChem CID:	92712254
Reduced:	OSN3C25H25 (1)
Stoich.:	ABC3D25E25 (1)
Weight, g/mol:	245.21435
ΔH_f, kcal/mol:	32.26
Dipole, Da:	5.52
IP(EA), eV:	-8.26(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-cyclohexylphenyl)-3-methylbutan-1-amine

Drug info:

PubChemData

Smile

C[C@H]1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=CC4=C(S3)N=C5C=CC(=CC5=C4)C

DOS

IR

Vibrations