Geometry & MOs

Info

ID:	204820
PubChem CID:	80013606
Reduced:	NSC19H37 (1)
Stoich.:	ABC19D37 (1)
Weight, g/mol:	309.249021
ΔH_f, kcal/mol:	-61.63
Dipole, Da:	2.82
IP(EA), eV:	-8.21(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(dicyclohexylamino)methyl]cyclopentyl]methanethiol

Drug info:

PubChemData

Smile

CC(C)(C)C(CN(C1CCCCC1)C2CCCCC2)CS

DOS

IR

Vibrations