Geometry & MOs

Info

ID:	256471
PubChem CID:	103139429
Reduced:	NO2H15C17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	279.231063
ΔH_f, kcal/mol:	-11.89
Dipole, Da:	5.68
IP(EA), eV:	-9.14(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3,5-diethyl-1-[(5-methyloxolan-2-yl)methyl]pyrazol-4-yl]propan-1-amine

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(C2=CC=CC3=C2C=NC=C3)O

DOS

IR

Vibrations