Geometry & MOs

Info

ID:	281374
PubChem CID:	103913777
Reduced:	NC12H17 (1)
Stoich.:	AB12C17 (1)
Weight, g/mol:	189.15175
ΔH_f, kcal/mol:	25.93
Dipole, Da:	1.1
IP(EA), eV:	-8.97(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[(1R)-1-phenylethyl]but-2-en-1-amine

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC(C)C=C

DOS

IR

Vibrations