Geometry & MOs

Info

ID:	430285
PubChem CID:	135170349
Reduced:	NC6H9 (4)
Stoich.:	AB6C9 (4)
Weight, g/mol:	406.309647
ΔH_f, kcal/mol:	-10.5
Dipole, Da:	3.46
IP(EA), eV:	-7.83(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-N,N,2-trimethyl-8-(4-pyrrolidin-1-ylbutyl)-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-9-amine

Drug info:

PubChemData

Smile

CC1CCC2=C(N1)C3=C(C=C(C(=C3)CCCN4CCCC4)C)N=C2NC(C)C

DOS

IR

Vibrations