Geometry & MOs

Info

ID:	424334
PubChem CID:	135122283
Reduced:	NOC5H5 (3)
Stoich.:	ABC5D5 (3)
Weight, g/mol:	324.12224
ΔH_f, kcal/mol:	-73.31
Dipole, Da:	4.19
IP(EA), eV:	-9.68(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-pyridin-3-yl-1H-indole-2-carbonyl)amino]ethylcarbamic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)NCCNC(=O)O

DOS

IR

Vibrations