Geometry & MOs

Info

ID:	271054
PubChem CID:	103641387
Reduced:	NC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	279.173548
ΔH_f, kcal/mol:	50.06
Dipole, Da:	2.94
IP(EA), eV:	-8.28(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-N-[(1-methylindazol-3-yl)methyl]methanamine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNCC2=CC=CC3=C2NC=C3

DOS

IR

Vibrations