Geometry & MOs

Info

ID:	312321
PubChem CID:	126604268
Reduced:	NC28H33 (1)
Stoich.:	AB28C33 (1)
Weight, g/mol:	453.324294
ΔH_f, kcal/mol:	47.01
Dipole, Da:	0.63
IP(EA), eV:	-7.81(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl 3-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methylamino]-2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CCC(C)C1=CC=C(C=C1)N(C2=CC=C(C=C2)C(C)CC)C3=CC=CC(=C3)C=C

DOS

IR

Vibrations