Geometry & MOs

Info

ID:	327471
PubChem CID:	126690014
Reduced:	NC14H25 (1)
Stoich.:	AB14C25 (1)
Weight, g/mol:	546.14042
ΔH_f, kcal/mol:	-29.53
Dipole, Da:	2.2
IP(EA), eV:	-8.93(1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[4-fluoro-3-(iodomethyl)phenyl]-7-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)quinazoline-4,6-diamine

Drug info:

PubChemData

Smile

C[C@@H](C1CCC2(C1)CCNCC2)C(=C)C

DOS

IR

Vibrations