Geometry & MOs

Info

ID:	210481
PubChem CID:	80812907
Reduced:	FN4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	273.15896
ΔH_f, kcal/mol:	-7.09
Dipole, Da:	1.15
IP(EA), eV:	-8.6(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-[[2-(methylamino)quinazolin-4-yl]amino]propanamide

Drug info:

PubChemData

Smile

CCNC1=NC(=CC(=N1)N(CC)C2=CC(=CC=C2)F)C

DOS

IR

Vibrations