Geometry & MOs

Info

ID:	148802
PubChem CID:	53788471
Reduced:	N2O7H16C17 (1)
Stoich.:	A2B7C16D17 (1)
Weight, g/mol:	216.089878
ΔH_f, kcal/mol:	-209.17
Dipole, Da:	7.85
IP(EA), eV:	-8.67(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydroindol-1-yl)-4,5-dihydro-1,3-oxazole-2-carbaldehyde

Drug info:

PubChemData

Smile

CC1C(=CC(=O)N2N1C=C(C3=C(C=C(C(=C32)C)C(=O)O)O)OC)C(=O)O

DOS

IR

Vibrations