Geometry & MOs

Info

ID:	371583
PubChem CID:	131269066
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-55.05
Dipole, Da:	2.07
IP(EA), eV:	-9.0(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-amino-8-propan-2-yl-2,3-dihydrochromen-4-yl)methanol

Drug info:

PubChemData

Smile

C=CC1=CC2=C(C=C1)C(CCO2)(CO)N

DOS

IR

Vibrations