Geometry & MOs

Info

ID:	292833
PubChem CID:	117360155
Reduced:	NO2C15H17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	243.137162
ΔH_f, kcal/mol:	-32.15
Dipole, Da:	2.3
IP(EA), eV:	-8.55(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-(2-methyl-3,4-dihydro-2H-chromen-7-yl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1=C2C=COC2=C(C3=C1OC=C3)C(C)CCN

DOS

IR

Vibrations