Geometry & MOs

Info

ID:	190565
PubChem CID:	78021160
Reduced:	N4O5C25H26 (1)
Stoich.:	A4B5C25D26 (1)
Weight, g/mol:	207.162314
ΔH_f, kcal/mol:	-92.12
Dipole, Da:	9.46
IP(EA), eV:	-8.91(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[benzyl(methyl)amino]-3-methylbutan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=CC(=C3)C(=O)N4CCNCC4C(=O)O

DOS

IR

Vibrations