Geometry & MOs

Info

ID:	281360
PubChem CID:	103913758
Reduced:	N2C15H18 (1)
Stoich.:	A2B15C18 (1)
Weight, g/mol:	175.1361
ΔH_f, kcal/mol:	43.38
Dipole, Da:	1.29
IP(EA), eV:	-9.09(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)CN[C@@H](C)C2=CC=CC=C2

DOS

IR

Vibrations