Geometry & MOs

Info

ID:	198463
PubChem CID:	79104542
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	264.220164
ΔH_f, kcal/mol:	50.27
Dipole, Da:	2.39
IP(EA), eV:	-8.81(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-butoxyethyl)pyrrol-3-yl]-cyclopropylmethyl]ethanamine

Drug info:

PubChemData

Smile

CCNC(C1CC1)C2=CN(C=C2)CC3=CC(=NO3)C

DOS

IR

Vibrations