Geometry & MOs

Info

ID:	172212
PubChem CID:	75480363
Reduced:	N2O3H12C16 (1)
Stoich.:	A2B3C12D16 (1)
Weight, g/mol:	199.076392
ΔH_f, kcal/mol:	24.97
Dipole, Da:	7.86
IP(EA), eV:	-9.61(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-3,4-dihydro-2H-chromen-4-amine;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC(=C2C=C(C=CC2=N1)[N+](=O)[O-])OC3=CC=CC=C3

DOS

IR

Vibrations