Geometry & MOs

Info

ID:	144998
PubChem CID:	53447187
Reduced:	ClC19H23 (1)
Stoich.:	AB19C23 (1)
Weight, g/mol:	246.148061
ΔH_f, kcal/mol:	-4.89
Dipole, Da:	2.93
IP(EA), eV:	-8.99(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2H-benzotriazol-4-yl)propyl]morpholine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)CC)C(C)Cl

DOS

IR

Vibrations