Geometry & MOs

Info

ID:	298599
PubChem CID:	117651700
Reduced:	O2N5C40H57 (1)
Stoich.:	A2B5C40D57 (1)
Weight, g/mol:	176.094963
ΔH_f, kcal/mol:	47.6
Dipole, Da:	4.84
IP(EA), eV:	-7.05(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-amino-2,3-dihydro-1H-indol-3-yl)acetaldehyde

Drug info:

PubChemData

Smile

CC1(CCC2(CCC3(C(=C(CC4C3(CCC5C4(CC6=C(C5(C)C)NN=C6N)C)C)C7=CN=C(C=C7)N8CCCC8)C2C1)C)C(=O)O)C

DOS

IR

Vibrations