Geometry & MOs

Info

ID:	256284
PubChem CID:	103138199
Reduced:	ON4C16H16 (1)
Stoich.:	AB4C16D16 (1)
Weight, g/mol:	199.193614
ΔH_f, kcal/mol:	42.26
Dipole, Da:	3.55
IP(EA), eV:	-7.99(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3-dimethyl-2-[(5-methyloxolan-2-yl)methyl]butan-1-amine

Drug info:

PubChemData

Smile

COC1=NC=CC(=C1)CNC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations