Geometry & MOs

Info

ID:	47841
PubChem CID:	10535589
Reduced:	NSO2C8H13 (1)
Stoich.:	ABC2D8E13 (1)
Weight, g/mol:	187.1361
ΔH_f, kcal/mol:	-82.58
Dipole, Da:	8.66
IP(EA), eV:	-9.19(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-methyl-2-phenyl-N-prop-2-ynylpropan-1-amine

Drug info:

PubChemData

Smile

CCN1C=CC(=C1C)S(=O)(=O)C

DOS

IR

Vibrations