Geometry & MOs

Info

ID:	204065
PubChem CID:	79907706
Reduced:	N4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	54.53
Dipole, Da:	2.8
IP(EA), eV:	-8.57(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1,9-dioxaspiro[5.5]undecan-4-yl(pyrimidin-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC(C)C1CN(C2=CC=CC=C2CN1)CC3=CN(N=C3)C

DOS

IR

Vibrations