Geometry & MOs

Info

ID:	440105
PubChem CID:	135230005
Reduced:	OF2N6C27H32 (1)
Stoich.:	AB2C6D27E32 (1)
Weight, g/mol:	312.220164
ΔH_f, kcal/mol:	-38.76
Dipole, Da:	2.66
IP(EA), eV:	-8.24(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)ethyl]-6-propan-2-ylnaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1CN2CCNC3=NC=C(N=C32)C4=CCC=C(C=C4)C(=O)NCCCCNC)F)F

DOS

IR

Vibrations