Geometry & MOs

Info

ID:	430268
PubChem CID:	135170332
Reduced:	ClN3C22H26 (1)
Stoich.:	AB3C22D26 (1)
Weight, g/mol:	337.251798
ΔH_f, kcal/mol:	33.72
Dipole, Da:	1.29
IP(EA), eV:	-8.72(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-propan-2-yl-3-(pyrrolidin-1-ylmethyl)-7,8,9,10-tetrahydrophenanthridin-6-amine

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=C1CCCCN3CCCC3)N=C(C4=C2N=CC=C4)Cl

DOS

IR

Vibrations