Geometry & MOs

Info

ID:	249853
PubChem CID:	103092527
Reduced:	ClN3C13H16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	167.1674
ΔH_f, kcal/mol:	53.28
Dipole, Da:	6.15
IP(EA), eV:	-8.72(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-cyclopentyl-N-ethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C=C/C1=C(N=C2N1C=CC=C2)Cl

DOS

IR

Vibrations