Geometry & MOs

Info

ID:	81507
PubChem CID:	49854802
Reduced:	FON2C17H17 (1)
Stoich.:	ABC2D17E17 (1)
Weight, g/mol:	311.199762
ΔH_f, kcal/mol:	-40.46
Dipole, Da:	5.31
IP(EA), eV:	-8.19(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(dimethylamino)phenyl]methyl]-3-methoxy-1-methyl-2H-indol-5-amine

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)CC2(C3=CC=CC=C3NC2=O)F

DOS

IR

Vibrations