Geometry & MOs

Info

ID:	188702
PubChem CID:	77757603
Reduced:	NO2C14H16 (2)
Stoich.:	AB2C14D16 (2)
Weight, g/mol:	351.231063
ΔH_f, kcal/mol:	-126.63
Dipole, Da:	3.73
IP(EA), eV:	-9.22(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(1,2,3,3a,4,8b-hexahydroindeno[1,2-c]pyrazol-3-yl)phenoxy]-N,N-diethylethanamine

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(CCC1=CC=CC=C1)C(=O)CO)NC(=O)C2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations