Geometry & MOs

Info

ID:	250005
PubChem CID:	103093472
Reduced:	NOC12H23 (1)
Stoich.:	ABC12D23 (1)
Weight, g/mol:	274.123676
ΔH_f, kcal/mol:	-65.67
Dipole, Da:	2.31
IP(EA), eV:	-8.61(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(5-chloroquinolin-8-yl)-N-ethyl-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)C(=CC1CCC(O1)C)C

DOS

IR

Vibrations