Geometry & MOs

Info

ID:	369537
PubChem CID:	127334559
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	315.194677
ΔH_f, kcal/mol:	-56.59
Dipole, Da:	2.38
IP(EA), eV:	-8.24(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxan-2-yl)-N-(2-propan-2-ylindazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)N1C=C2C=C(C=CC2=N1)NC(=O)C3CCCN(C3)C(=O)C

DOS

IR

Vibrations